Comparing distance metrics for rotation using the k-nearest neighbors algorithm for entropy estimation

Copyright © 2013 The Authors. Journal of Computational Chemistry published by Wiley Periodicals, Inc.

Détails bibliographiques
Publié dans:Journal of computational chemistry. - 1984. - 35(2014), 5 vom: 15. Feb., Seite 377-85
Auteur principal: Huggins, David J (Auteur)
Format: Article en ligne
Langue:English
Publié: 2014
Accès à la collection:Journal of computational chemistry
Sujets:Comparative Study Journal Article Research Support, Non-U.S. Gov't distance metric entropy k-nearest neighbors molecular dynamics solvation statistical mechanics Water 059QF0KO0R